2-[4-[2-(1H-imidazol-5-yl)ethyl]phenyl]ethyl 4-chloranylbenzoate

Systemtic Name: 2-[4-[2-(1H-imidazol-5-yl)ethyl]phenyl]ethyl 4-chloranylbenzoate Openeye Name: 2-[4-[2-(1H-imidazol-5-yl)ethyl]phenyl]ethyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid 2-[4-[2-(1H-imidazol-5-yl)ethyl]phenyl]ethyl ester IUPAC Name: 2-[4-[2-(1H-imidazol-5-yl)ethyl]phenyl]ethyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid 2-[4-[2-(1H-imidazol-5-yl)ethyl]phenyl]ethyl ester Formula: C20H19ClN2O2 MolecularWeight: 354.83006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC2=CN=CN2)CCOC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1CCC2=CN=CN2)CCOC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O2/c21-18-8-6-17(7-9-18)20(24)25-12-11-16-3-1-15(2-4-16)5-10-19-13-22-14-23-19/h1-4,6-9,13-14H,5,10-12H2,(H,22,23)